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Molecule record

(2S,3R,4R,5S,6R)-2-[4-chloro-3-[[4-[(3S)-oxolan-3-yl]oxyphenyl]methyl]phenyl]-6-(hydroxymethyl)oxane-3,4,5-triol

C23H27ClO7

450.92 g/mol

Loading structure

Molecular properties

Formula
C23H27ClO7
Molar mass
450.92 g·mol−1
Exact mass
450.1445 Da
10
PubChem CID
11949646

Functional groups

Alcohol
Alkane / alkyl carbon
Aromatic ring
Aryl halide
Ether

Physical properties

No source-backed physical properties are curated for this molecule yet.

Common names and synonyms

  • (1S)-1,5-Anhydro-1-C-[4-chloro-3-[[4-[[(3S)-tetrahydro-3-furanyl]oxy]phenyl]methyl]phenyl]-D-glucitol
  • (1S)-1,5-anhydro-1-(4-chloro-3-{4-[(3S)-tetrahydrofuran-3-yloxy]benzyl}phenyl)-D-glucitol
  • (1S)-1,5-anhydro-1-C-{4-chloro-3-((4-{((3S)-oxolan-3-yl)oxy}phenyl)methyl)phenyl}-D-glucitol
  • 1-chloro-4-(glucopyranos-1-yl)-2-(4-(tetrahydrofuran-3-yloxy)benzyl)benzene
  • 864070-44-0
  • A10BK03
  • BI 10773
  • BI10773
Show all 24 synonyms
  • CHEBI:82720
  • D-Glucitol, 1,5-anhydro-1-C-(4-chloro-3-((4-(((3S)-tetrahydro-3-furanyl)oxy)phenyl)methyl)phenyl)-, (1S)-
  • DTXCID901510350
  • DTXSID601026093
  • Empagliflozin
  • Empagliflozin (BI 10773)
  • Empagliflozin [USAN:INN]
  • Empagliflozina
  • Empagliflozine
  • Empagliflozinum
  • GLYXAMBI COMPONENT EMPAGLIFLOZIN
  • HDC1R2M35U
  • JARDIANCE
  • MFCD22566222
  • RefChem:5790
  • TRIJARDY XR COMPONENT EMPAGLIFLOZIN

Structure identifiers

Canonical SMILES
OC[C@H]1O[C@@H](c2ccc(Cl)c(Cc3ccc(O[C@H]4CCOC4)cc3)c2)[C@H](O)[C@@H](O)[C@@H]1O
Isomeric SMILES
C1COC[C@H]1OC2=CC=C(C=C2)CC3=C(C=CC(=C3)[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)CO)O)O)O)Cl
InChI
InChI=1S/C23H27ClO7/c24-18-6-3-14(23-22(28)21(27)20(26)19(11-25)31-23)10-15(18)9-13-1-4-16(5-2-13)30-17-7-8-29-12-17/h1-6,10,17,19-23,25-28H,7-9,11-12H2/t17-,19+,20+,21-,22+,23-/m0/s1
InChIKey
OBWASQILIWPZMG-QZMOQZSNSA-N
PubChem CID
11949646

Spectroscopy

Tabs appear only for spectra stored with clear provenance.

Open library
No redistributable or simulated spectroscopy record is attached yet.

Simulated NMR

On-demand educational prediction for (2S,3R,4R,5S,6R)-2-[4-chloro-3-[[4-[(3S)-oxolan-3-yl]oxyphenyl]methyl]phenyl]-6-(hydroxymethyl)oxane-3,4,5-triol; not experimental data.

Simulated EI mass spectrum

On-demand educational fragmentation for (2S,3R,4R,5S,6R)-2-[4-chloro-3-[[4-[(3S)-oxolan-3-yl]oxyphenyl]methyl]phenyl]-6-(hydroxymethyl)oxane-3,4,5-triol; not experimental data.

Sources

Molecule identity

Retrieved 8/20/2026. Reuse status is summarized by the badge; open the source for full details.

PubChem(link only)
Open source record